CID 17983253

1,3,5-trimethylpiperazine

Structural Information

Molecular Formula

C₇H₁₆N₂

SMILES

CC1CN(CC(N1)C)C

InChI

InChI=1S/C7H16N2/c1-6-4-9(3)5-7(2)8-6/h6-8H,4-5H2,1-3H3

InChIKey

CLPZHEDSMNQBPP-UHFFFAOYSA-N

Compound name

1,3,5-trimethylpiperazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 713
Patents: 128.13135 Da
Monoisotopic Mass: 0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	129.13863	129.7
[M+Na]+	151.12057	141.0
[M+NH4]+	146.16517	138.0
[M+K]+	167.09451	135.1
[M-H]-	127.12407	130.5
[M+Na-2H]-	149.10602	134.2
[M]+	128.13080	131.3
[M]-	128.13190	131.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe